benzyl N-methyl-N-(2-methylquinolin-6-yl)carbamate

C19H18N2O2 — CID 71379552

IUPACbenzyl N-methyl-N-(2-methylquinolin-6-yl)carbamate
SMILESCc1ccc2cc(N(C)C(=O)OCc3ccccc3)ccc2n1
InChIInChI=1S/C19H18N2O2/c1-14-8-9-16-12-17(10-11-18(16)20-14)21(2)19(22)23-13-15-6-4-3-5-7-15/h3-12H,13H2,1-2H3
InChIKeyQFOZOFMGDFEFNK-UHFFFAOYSA-N
MW306.36 g/mol
LogP4.32
Rot. Bonds3

About benzyl N-methyl-N-(2-methylquinolin-6-yl)carbamate

benzyl N-methyl-N-(2-methylquinolin-6-yl)carbamate (PubChem CID 71379552) has the molecular formula C19H18N2O2 and a molecular weight of 306.36 g/mol. Its IUPAC name is benzyl N-methyl-N-(2-methylquinolin-6-yl)carbamate.

Molecular Properties

Compound Namebenzyl N-methyl-N-(2-methylquinolin-6-yl)carbamate
PubChem CID71379552
Molecular FormulaC19H18N2O2
Molecular Weight306.36 g/mol
Exact Mass306.14
IUPAC Namebenzyl N-methyl-N-(2-methylquinolin-6-yl)carbamate
SMILESCc1ccc2cc(N(C)C(=O)OCc3ccccc3)ccc2n1
InChIInChI=1S/C19H18N2O2/c1-14-8-9-16-12-17(10-11-18(16)20-14)21(2)19(22)23-13-15-6-4-3-5-7-15/h3-12H,13H2,1-2H3
InChIKeyQFOZOFMGDFEFNK-UHFFFAOYSA-N
XLogP4.32
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.36
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

benzyl N-(3-carbonochloridoylphenyl)-N-methylcarbamate
CID 87413582
CID 156800719
CID 156800719
2-methyl-6-phenylmethoxyquinoline
CID 82580854
benzyl N-methyl-N-(4-nitrophenyl)carbamate
CID 102148526
benzyl N,N-dimethylcarbamate
CID 12963450
tert-butyl 2-[2-amino-4-[methyl(phenylmethoxycarbonyl)amino]phenoxy]acetate
CID 89143806
(4-methylphenyl)methyl N-(3-carbamoylphenyl)-N-methylcarbamate
CID 70033297
benzyl N-[3-(aminomethyl)-5-propan-2-ylphenyl]-N-methylcarbamate
CID 59570072
benzyl N-(3-bromo-5-cyanophenyl)-N-methylcarbamate
CID 68671106
benzyl 2-methylquinoline-4-carboxylate
CID 804130
benzyl N-[3-(2,4-dioxo-1H-pyrimidin-6-yl)phenyl]-N-methylcarbamate
CID 22618157
benzyl N-methyl-N-prop-2-ynoxycarbamate
CID 90159328

Frequently Asked Questions

What is the IUPAC name of benzyl N-methyl-N-(2-methylquinolin-6-yl)carbamate?
The IUPAC name of benzyl N-methyl-N-(2-methylquinolin-6-yl)carbamate (CID 71379552) is benzyl N-methyl-N-(2-methylquinolin-6-yl)carbamate.
What is the SMILES notation for benzyl N-methyl-N-(2-methylquinolin-6-yl)carbamate?
The canonical SMILES for benzyl N-methyl-N-(2-methylquinolin-6-yl)carbamate is Cc1ccc2cc(N(C)C(=O)OCc3ccccc3)ccc2n1.
What is the InChIKey of benzyl N-methyl-N-(2-methylquinolin-6-yl)carbamate?
The InChIKey is QFOZOFMGDFEFNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-14-8-9-16-12-17(10-11-18(16)20-14)21(2)19(22)23-13-15-6-4-3-5-7-15/h3-12H,13H2,1-2H3.
What are the key properties of benzyl N-methyl-N-(2-methylquinolin-6-yl)carbamate?
benzyl N-methyl-N-(2-methylquinolin-6-yl)carbamate has a molecular weight of 306.36 g/mol, XLogP of 4.32, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl N-methyl-N-(2-methylquinolin-6-yl)carbamate is sourced from PubChem (CID 71379552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).